COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL417348
Chemical Name: {3-[(Z)-{5-[(4-chlorophenyl)amino]-4-(ethoxycarbonyl)-3-oxothiophen-2(3H)-ylidene}methyl]-1H-indol-1-yl}aceticacid
Smiles: CCOC(=O)C1=C(Nc2ccc(cc2)Cl)S/C(=C\c2cn(c3c2cccc3)CC(=O)O)/C1=O

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Molecular Weight: 482.94
Empirical Formula: C24H19ClN2O5S

Physical State: Dry powder
Available Amount: 169 mg

Lipinsky:
logP: 5.511
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 122
Number of rings: 4

     

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